(2E)-2-[(1-phenylsulfanylcyclopropyl)methylidene]cyclohexan-1-one

Systemtic Name: (2E)-2-[(1-phenylsulfanylcyclopropyl)methylidene]cyclohexan-1-one Openeye Name: (2E)-2-[(1-phenylsulfanylcyclopropyl)methylene]cyclohexanone CAS Name: (2E)-2-[[1-(phenylthio)cyclopropyl]methylidene]-1-cyclohexanone IUPAC Name: (2E)-2-[(1-phenylsulfanylcyclopropyl)methylidene]cyclohexan-1-one Traditional Name: (2E)-2-[[1-(phenylthio)cyclopropyl]methylene]cyclohexanone Formula: C16H18OS MolecularWeight: 258.37852

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(=CC2(CC2)SC3=CC=CC=C3)C1

Isomeric SMILES

C1CCC(=O)/C(=C/C2(CC2)SC3=CC=CC=C3)/C1

InChI

InChI=1S/C16H18OS/c17-15-9-5-4-6-13(15)12-16(10-11-16)18-14-7-2-1-3-8-14/h1-3,7-8,12H,4-6,9-11H2/b13-12+